Dataset

3',6-Dimethylflavone

This MassBank record with Accession MSBNK-Washington_State_Univ-BML01491 contains the MS2 mass spectrum of 3',6-Dimethylflavone with the InChIkey JAFAHOKDGKCLNO-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H14O2/c1-11-4-3-5-13(8-11)17-10-15(18)14-9-12(2)6-7-16(14)19-17/h3-10H,1-2H3
SMILES CC1=CC2=C(C=C1)OC(=CC2=O)C3=CC(=CC=C3)C
InChI Key JAFAHOKDGKCLNO-UHFFFAOYSA-N
Molecular Formula C17H14O2
Exact Mass 250.099 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML01491
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:26:32.380260
MetadataModified 2024-01-11T22:26:32.535908
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
688822 PubChem
15565080 PubChem: Thomson Pharma
J1.206.804B Nikkaji
MCULE-3173300950 Mcule
ZINC000000057868 ZINC
CHEMBL137498 ChEMBL
4368484 eMolecules
The data in this table is sourced from UniChem at EBI.